CAS RN: 71270-61-6
N-(3-CHLORO-4-METHYLPHENYL)METHANESULFONAMIDE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250730 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS71270-61-6
- Purity/Analytical Methods: >99.0%
71270-61-6 / N-(3-chloro-4-methylphenyl)methanesulfonamide
Basic Information
CAS
71270-61-6
Multi CAS
No
Molecular Formula
C8H10CLNO2S
Molecular Weight
219.690000
Exact Mass
219.012077
InChI
InChI=1S/C8H10ClNO2S/c1-6-3-4-7(5-8(6)9)10-13(2,11)12/h3-5,10H,1-2H3
InChIKey
IECJHCNQWJZFEH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
54.66
TPSA
46.17
LogP / Solubility
WLOGP
2.02
MLOGP
1.78
XLogP3
2.5
Consensus LogP
2.1
Log S (ESOL)
-2.68
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.82
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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